ethyl 3-(2-methoxy-2-oxidanylidene-ethyl)-2-[2-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfonylethanoylimino]-1,3-benzothiazole-6-carboxylate

Systemtic Name: ethyl 3-(2-methoxy-2-oxidanylidene-ethyl)-2-[2-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfonylethanoylimino]-1,3-benzothiazole-6-carboxylate Openeye Name: ethyl 3-(2-methoxy-2-oxo-ethyl)-2-[2-(2-morpholino-2-oxo-ethyl)sulfonylacetyl]imino-1,3-benzothiazole-6-carboxylate CAS Name: 3-(2-methoxy-2-oxoethyl)-2-[2-[2-(4-morpholinyl)-2-oxoethyl]sulfonyl-1-oxoethyl]imino-1,3-benzothiazole-6-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(2-methoxy-2-oxoethyl)-2-[2-(2-morpholin-4-yl-2-oxoethyl)sulfonylacetyl]imino-1,3-benzothiazole-6-carboxylate Traditional Name: 3-(2-keto-2-methoxy-ethyl)-2-[2-(2-keto-2-morpholino-ethyl)sulfonylacetyl]imino-1,3-benzothiazole-6-carboxylic acid ethyl ester Formula: C21H25N3O9S2 MolecularWeight: 527.5679

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)N(C(=NC(=O)CS(=O)(=O)CC(=O)N3CCOCC3)S2)CC(=O)OC

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)N(C(=NC(=O)CS(=O)(=O)CC(=O)N3CCOCC3)S2)CC(=O)OC

InChI

InChI=1S/C21H25N3O9S2/c1-3-33-20(28)14-4-5-15-16(10-14)34-21(24(15)11-19(27)31-2)22-17(25)12-35(29,30)13-18(26)23-6-8-32-9-7-23/h4-5,10H,3,6-9,11-13H2,1-2H3